data_nef_c25681_2n4u save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 25678 BMRB 25679 BMRB 25680 BMRB 25682 BMRB 25683 PDB 2N4U stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 428 GLY start . false 2 A 429 ALA middle . . 3 A 430 THR middle . . 4 A 431 ALA middle . . 5 A 432 VAL middle . . 6 A 433 SER middle . . 7 A 434 GLU middle . . 8 A 435 TRP middle . . 9 A 436 THR middle . . 10 A 437 GLU middle . . 11 A 438 TYR middle . . 12 A 439 LYS middle . . 13 A 440 THR middle . . 14 A 441 ALA middle . . 15 A 442 ASP middle . . 16 A 443 GLY middle . false 17 A 444 LYS middle . . 18 A 445 THR middle . . 19 A 446 TYR middle . . 20 A 447 TYR middle . . 21 A 448 TYR middle . . 22 A 449 ASN middle . . 23 A 450 ASN middle . . 24 A 451 ARG middle . . 25 A 452 THR middle . . 26 A 453 LEU middle . . 27 A 454 TYR middle . . 28 A 455 SER middle . . 29 A 456 THR middle . . 30 A 457 TRP middle . . 31 A 458 GLU middle . . 32 A 459 LYS middle . . 33 A 460 PRO middle . false 34 A 461 GLN middle . . 35 A 462 GLU middle . . 36 A 463 LEU middle . . 37 A 464 LYS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 428 GLY HAy H 1 3.889 0.010 A 429 ALA H H 1 8.108 0.010 A 429 ALA HA H 1 4.124 0.010 A 430 THR H H 1 8.212 0.010 A 430 THR HA H 1 4.098 0.010 A 430 THR HB H 1 4.056 0.010 A 431 ALA H H 1 8.160 0.010 A 431 ALA HA H 1 4.140 0.010 A 432 VAL H H 1 8.058 0.010 A 432 VAL HA H 1 3.893 0.010 A 432 VAL HB H 1 1.859 0.010 A 433 SER H H 1 8.231 0.010 A 433 SER HA H 1 4.289 0.010 A 433 SER HBy H 1 3.813 0.010 A 433 SER HBx H 1 3.710 0.010 A 434 GLU H H 1 8.645 0.010 A 434 GLU HA H 1 3.918 0.010 A 434 GLU HBy H 1 1.725 0.010 A 434 GLU HBx H 1 1.654 0.010 A 434 GLU HGy H 1 1.687 0.010 A 434 GLU HGx H 1 1.676 0.010 A 435 TRP H H 1 8.030 0.010 A 435 TRP HA H 1 5.259 0.010 A 435 TRP HBy H 1 2.896 0.010 A 435 TRP HBx H 1 2.756 0.010 A 435 TRP HD1 H 1 7.017 0.010 A 435 TRP HE1 H 1 10.099 0.010 A 435 TRP HE3 H 1 7.172 0.010 A 435 TRP HH2 H 1 7.067 0.001 A 435 TRP HZ2 H 1 7.382 0.001 A 435 TRP HZ3 H 1 6.783 0.003 A 436 THR H H 1 9.350 0.010 A 436 THR HA H 1 4.334 0.010 A 436 THR HB H 1 3.684 0.010 A 437 GLU H H 1 8.374 0.010 A 437 GLU HA H 1 4.238 0.010 A 437 GLU HBy H 1 1.629 0.010 A 437 GLU HBx H 1 1.622 0.010 A 437 GLU HGx H 1 1.587 0.010 A 438 TYR H H 1 8.346 0.010 A 438 TYR HA H 1 4.321 0.001 A 438 TYR HBy H 1 2.286 0.010 A 438 TYR HBx H 1 0.922 0.010 A 438 TYR HDy H 1 6.607 0.001 A 438 TYR HEy H 1 6.348 0.010 A 439 LYS H H 1 7.998 0.010 A 439 LYS HA H 1 5.277 0.010 A 439 LYS HBy H 1 1.492 0.034 A 439 LYS HBx H 1 1.145 0.010 A 439 LYS HDy H 1 1.284 0.010 A 439 LYS HDx H 1 1.268 0.010 A 439 LYS HEx H 1 2.658 0.010 A 439 LYS HGy H 1 1.419 0.002 A 439 LYS HGx H 1 1.334 0.010 A 440 THR H H 1 9.066 0.010 A 440 THR HA H 1 4.446 0.010 A 440 THR HB H 1 4.432 0.010 A 441 ALA H H 1 7.818 0.010 A 441 ALA HA H 1 3.963 0.002 A 442 ASP H H 1 7.904 0.010 A 442 ASP HA H 1 4.452 0.010 A 442 ASP HBy H 1 2.645 0.010 A 442 ASP HBx H 1 2.446 0.010 A 443 GLY H H 1 7.819 0.010 A 443 GLY HAx H 1 3.434 0.010 A 443 GLY HAy H 1 3.958 0.003 A 444 LYS H H 1 7.726 0.010 A 444 LYS HA H 1 4.343 0.010 A 444 LYS HBy H 1 1.803 0.010 A 444 LYS HBx H 1 1.766 0.010 A 444 LYS HDy H 1 1.317 0.010 A 444 LYS HDx H 1 1.286 0.010 A 444 LYS HEx H 1 2.485 0.001 A 444 LYS HGy H 1 1.155 0.010 A 444 LYS HGx H 1 1.092 0.010 A 445 THR H H 1 8.536 0.010 A 445 THR HA H 1 4.797 0.010 A 445 THR HB H 1 3.712 0.010 A 446 TYR H H 1 8.612 0.010 A 446 TYR HA H 1 4.509 0.010 A 446 TYR HBy H 1 2.205 0.001 A 446 TYR HBx H 1 2.046 0.010 A 446 TYR HDy H 1 6.505 0.010 A 446 TYR HEy H 1 6.118 0.010 A 447 TYR H H 1 8.656 0.002 A 447 TYR HA H 1 4.910 0.002 A 447 TYR HBy H 1 2.510 0.004 A 447 TYR HBx H 1 2.465 0.010 A 447 TYR HDy H 1 6.506 0.010 A 447 TYR HEy H 1 6.472 0.010 A 448 TYR H H 1 9.257 0.010 A 448 TYR HA H 1 5.255 0.010 A 448 TYR HBy H 1 2.827 0.001 A 448 TYR HBx H 1 2.676 0.010 A 448 TYR HDy H 1 6.811 0.010 A 448 TYR HEy H 1 6.412 0.010 A 449 ASN H H 1 8.232 0.010 A 449 ASN HA H 1 4.051 0.010 A 449 ASN HBy H 1 2.178 0.003 A 449 ASN HBx H 1 0.310 0.010 A 449 ASN HD2y H 1 7.154 0.010 A 449 ASN HD2x H 1 7.076 0.010 A 450 ASN H H 1 8.441 0.010 A 450 ASN HA H 1 3.988 0.010 A 450 ASN HBy H 1 2.518 0.010 A 450 ASN HBx H 1 2.490 0.010 A 450 ASN HD2y H 1 7.158 0.010 A 450 ASN HD2x H 1 7.093 0.010 A 451 ARG H H 1 8.342 0.010 A 451 ARG HA H 1 4.087 0.010 A 451 ARG HBy H 1 1.727 0.010 A 451 ARG HBx H 1 1.260 0.010 A 451 ARG HDy H 1 3.012 0.010 A 451 ARG HDx H 1 2.807 0.010 A 451 ARG HE H 1 7.721 0.010 A 451 ARG HGy H 1 1.465 0.010 A 451 ARG HGx H 1 1.084 0.010 A 452 THR H H 1 7.804 0.010 A 452 THR HA H 1 3.813 0.010 A 452 THR HB H 1 3.956 0.010 A 453 LEU H H 1 7.586 0.010 A 453 LEU HA H 1 3.583 0.010 A 453 LEU HBy H 1 1.906 0.010 A 453 LEU HBx H 1 1.386 0.010 A 453 LEU HG H 1 1.054 0.010 A 454 TYR H H 1 6.784 0.010 A 454 TYR HA H 1 4.490 0.010 A 454 TYR HBy H 1 2.694 0.010 A 454 TYR HBx H 1 2.524 0.010 A 454 TYR HDy H 1 6.918 0.010 A 454 TYR HEy H 1 6.651 0.010 A 455 SER H H 1 7.746 0.003 A 455 SER HA H 1 5.676 0.010 A 455 SER HBy H 1 3.445 0.010 A 455 SER HBx H 1 3.416 0.010 A 456 THR H H 1 8.970 0.010 A 456 THR HA H 1 4.500 0.010 A 456 THR HB H 1 4.057 0.010 A 457 TRP H H 1 8.297 0.010 A 457 TRP HA H 1 4.791 0.010 A 457 TRP HBy H 1 3.395 0.010 A 457 TRP HBx H 1 2.977 0.010 A 457 TRP HD1 H 1 7.173 0.001 A 457 TRP HE1 H 1 9.982 0.001 A 457 TRP HE3 H 1 7.888 0.010 A 457 TRP HH2 H 1 6.883 0.001 A 457 TRP HZ2 H 1 7.150 0.010 A 457 TRP HZ3 H 1 6.690 0.010 A 458 GLU H H 1 8.112 0.010 A 458 GLU HA H 1 4.116 0.010 A 458 GLU HBy H 1 1.608 0.010 A 458 GLU HBx H 1 1.580 0.010 A 458 GLU HGy H 1 1.904 0.010 A 458 GLU HGx H 1 1.856 0.010 A 459 LYS H H 1 8.215 0.010 A 459 LYS HA H 1 2.496 0.010 A 459 LYS HBy H 1 1.174 0.010 A 459 LYS HBx H 1 0.794 0.010 A 459 LYS HDy H 1 1.224 0.010 A 459 LYS HDx H 1 1.149 0.010 A 459 LYS HEx H 1 2.586 0.010 A 459 LYS HGy H 1 0.323 0.010 A 459 LYS HGx H 1 0.299 0.010 A 460 PRO HA H 1 3.752 0.001 A 460 PRO HBy H 1 1.168 0.010 A 460 PRO HBx H 1 0.900 0.010 A 460 PRO HDy H 1 2.470 0.010 A 460 PRO HDx H 1 1.933 0.010 A 460 PRO HGy H 1 -0.057 0.010 A 460 PRO HGx H 1 -0.169 0.010 A 461 GLN H H 1 8.374 0.010 A 461 GLN HA H 1 3.560 0.010 A 461 GLN HBy H 1 1.812 0.010 A 461 GLN HBx H 1 1.765 0.010 A 461 GLN HE2y H 1 7.414 0.010 A 461 GLN HE2x H 1 6.715 0.010 A 461 GLN HGx H 1 2.142 0.010 A 462 GLU H H 1 9.015 0.010 A 462 GLU HA H 1 3.917 0.010 A 462 GLU HBy H 1 1.840 0.010 A 462 GLU HBx H 1 1.762 0.010 A 462 GLU HGy H 1 2.093 0.010 A 462 GLU HGx H 1 2.090 0.010 A 463 LEU H H 1 7.335 0.010 A 463 LEU HA H 1 4.192 0.010 A 463 LEU HBy H 1 1.378 0.001 A 463 LEU HBx H 1 1.022 0.010 A 463 LEU HG H 1 1.089 0.010 A 464 LYS H H 1 7.414 0.010 A 464 LYS HA H 1 3.734 0.010 A 464 LYS HBy H 1 1.574 0.010 A 464 LYS HBx H 1 1.481 0.010 A 464 LYS HDx H 1 1.375 0.010 A 464 LYS HEx H 1 2.659 0.010 A 464 LYS HGy H 1 1.163 0.010 A 464 LYS HGx H 1 1.001 0.010 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 439 LYS HA A 440 THR H 1.0 1.48320000000 2.48320000000 2 2 A 439 LYS HA A 446 TYR H 1.0 1.90622307692 4.61437692308 3 3 A 448 TYR HA A 449 ASN H 1.0 1.73296153846 3.28603846154 4 4 A 447 TYR HA A 448 TYR H 1.0 1.73171538462 3.27648461538 5 5 A 439 LYS HA A 445 THR HA 1.0 1.91067692308 4.64852307692 6 6 A 446 TYR HA A 447 TYR H 1.0 1.75924615385 3.48755384615 7 7 A 446 TYR H A 445 THR HA 1.0 1.44180000000 2.44180000000 8 8 A 436 THR HB A 437 GLU H 1.0 1.96760769231 5.08499230769 9 9 A 437 GLU H A 436 THR HA 1.0 1.25000000000 2.25000000000 10 10 A 449 ASN HA A 450 ASN H 1.0 1.68152307692 2.89167692308 11 11 A 450 ASN HA A 451 ARG H 1.0 1.95343846154 4.97636153846 12 12 A 451 ARG HA A 452 THR H 1.0 1.96929230769 5.09790769231 13 13 A 444 LYS HA A 445 THR H 1.0 1.39920000000 2.39920000000 14 14 A 433 SER HA A 434 GLU H 1.0 1.80417692308 3.83202307692 15 15 A 434 GLU H A 433 SER HBy 1.0 2.06183076923 5.80736923077 16 16 A 434 GLU H A 433 SER HBx 1.0 2.05520769231 5.75659230769 17 17 A 432 VAL HA A 433 SER H 1.0 1.77154615385 3.58185384615 18 18 A 431 ALA HA A 432 VAL H 1.0 1.79997692308 3.79982307692 19 19 A 440 THR HB A 441 ALA H 1.0 1.89456923077 4.52503076923 20 20 A 441 ALA H A 440 THR HA 1.0 1.85400000000 4.21400000000 21 21 A 440 THR H A 445 THR HA 1.0 1.94612307692 4.92027692308 22 22 A 441 ALA HA A 442 ASP H 1.0 1.97439230769 5.13700769231 23 23 A 442 ASP HA A 443 GLY H 1.0 1.85400000000 4.21400000000 24 24 A 461 GLN HA A 462 GLU H 1.0 1.91067692308 4.64852307692 25 25 A 462 GLU H A 460 PRO HA 1.0 2.09739230769 6.08000769231 26 26 A 460 PRO HA A 461 GLN H 1.0 1.50300000000 2.50300000000 27 27 A 462 GLU HA A 463 LEU H 1.0 1.91762307692 4.70177692308 28 28 A 432 VAL H A 431 ALA HB1 1.0 2.08848461538 6.01171538462 29 29 A 433 SER H A 432 VAL HG21 1.0 2.06646923077 5.84293076923 30 30 A 433 SER H A 432 VAL HB 1.0 2.00981538462 5.40858461538 31 31 A 437 GLU H A 436 THR HG21 1.0 1.89053076923 4.49406923077 32 32 A 440 THR H A 439 LYS HGy 1.0 1.94900769231 4.94239230769 33 33 A 440 THR H A 439 LYS HBy 1.0 1.88755384615 4.47124615385 34 34 A 440 THR H A 439 LYS HBx 1.0 1.94757692308 4.93142307692 35 35 A 442 ASP H A 441 ALA HB1 1.0 1.99696153846 5.31003846154 36 36 A 443 GLY H A 442 ASP HBy 1.0 2.03727692308 5.61912307692 37 37 A 443 GLY HAy A 444 LYS H 1.0 2.00323846154 5.35816153846 38 38 A 444 LYS H A 443 GLY HAx 1.0 1.88083846154 4.41976153846 39 39 A 445 THR H A 444 LYS HBx 1.0 1.84239230769 4.12500769231 40 40 A 446 TYR H A 445 THR HG21 1.0 1.89558461538 4.53281538462 41 41 A 447 TYR H A 446 TYR HBy 1.0 1.89662307692 4.54077692308 42 42 A 447 TYR H A 446 TYR HBx 1.0 1.81862307692 3.94277692308 43 43 A 448 TYR H A 447 TYR HBy 1.0 1.97614615385 5.15045384615 44 44 A 450 ASN H A 449 ASN HBy 1.0 2.11776923077 6.23623076923 45 45 A 450 ASN H A 449 ASN HBx 1.0 2.07630000000 5.91830000000 46 46 A 451 ARG H A 450 ASN HBy 1.0 1.96596923077 5.07243076923 47 47 A 451 ARG H A 450 ASN HBx 1.0 1.96273846154 5.04766153846 48 48 A 452 THR H A 451 ARG HGy 1.0 1.90843846154 4.63136153846 49 49 A 452 THR H A 451 ARG HBx 1.0 2.02659230769 5.53720769231 50 50 A 452 THR H A 451 ARG HBy 1.0 1.87170000000 4.34970000000 51 51 A 451 ARG H A 452 THR H 1.0 1.74588461538 3.38511538462 52 52 A 462 GLU H A 461 GLN H 1.0 1.97614615385 5.15045384615 53 53 A 462 GLU H A 463 LEU H 1.0 1.96596923077 5.07243076923 54 54 A 463 LEU H A 464 LYS H 1.0 1.73464615385 3.29895384615 55 55 A 448 TYR H A 436 THR H 1.0 1.87712307692 4.39127692308 56 56 A 458 GLU HA A 459 LYS H 1.0 1.41830000000 2.41830000000 57 57 A 459 LYS H A 458 GLU HBy 1.0 1.94053846154 4.87746153846 58 58 A 461 GLN H A 460 PRO HBx 1.0 1.94757692308 4.93142307692 59 59 A 462 GLU H A 460 PRO HBx 1.0 2.00323846154 5.35816153846 60 60 A 462 GLU H A 461 GLN HBy 1.0 1.93380000000 4.82580000000 61 61 A 463 LEU H A 462 GLU HGy 1.0 1.99493076923 5.29446923077 62 62 A 463 LEU H A 462 GLU HBy 1.0 2.08022307692 5.94837692308 63 63 A 464 LYS H A 463 LEU HBx 1.0 1.93781538462 4.85658461538 64 64 A 448 TYR HBy A 446 TYR HE% 1.0 2.06884615385 5.86115384615 65 65 A 446 TYR HE% A 440 THR HG21 1.0 1.95673846154 5.00166153846 66 66 A 440 THR HG21 A 446 TYR HD% 1.0 1.96061538462 5.03138461538 67 67 A 460 PRO HDx A 447 TYR HD% 1.0 2.02158461538 5.49881538462 68 68 A 447 TYR HD% A 463 LEU HD21 1.0 2.01833076923 5.47386923077 69 69 A 445 THR HG21 A 447 TYR HE% 1.0 2.00907692308 5.40292307692 70 70 A 463 LEU HD21 A 447 TYR HE% 1.0 2.03820000000 5.62620000000 71 71 A 447 TYR HE% A 437 GLU HGx 1.0 1.89152307692 4.50167692308 72 72 A 460 PRO HDx A 447 TYR HE% 1.0 2.04295384615 5.66264615385 73 73 A 450 ASN HBy A 448 TYR HE% 1.0 1.97353846154 5.13046153846 74 74 A 446 TYR HE% A 448 TYR HD% 1.0 2.09739230769 6.08000769231 75 75 A 446 TYR HE% A 448 TYR HD% 1.0 2.06097692308 5.80082307692 76 76 A 436 THR HB A 448 TYR HD% 1.0 2.00538461538 5.37461538462 77 77 A 447 TYR HD% A 460 PRO HGy 1.0 2.19424615385 6.82255384615 78 78 A 447 TYR HD% A 460 PRO HGx 1.0 2.15450769231 6.51789230769 79 79 A 439 LYS HA A 446 TYR HD% 1.0 2.01673846154 5.46166153846 80 80 A 439 LYS HA A 446 TYR HE% 1.0 2.04443076923 5.67396923077 81 81 A 447 TYR HE% A 437 GLU HBx 1.0 1.83507692308 4.06892307692 82 82 A 447 TYR HD% A 437 GLU HA 1.0 1.98242307692 5.19857692308 83 83 A 447 TYR HE% A 437 GLU HA 1.0 2.03727692308 5.61912307692 84 84 A 447 TYR HD% A 460 PRO HDy 1.0 1.80087692308 3.80672307692 85 85 A 447 TYR HE% A 460 PRO HDy 1.0 1.89053076923 4.49406923077 86 86 A 433 SER H A 432 VAL H 1.0 2.00757692308 5.39142307692 87 87 A 443 GLY H A 442 ASP HBx 1.0 2.07630000000 5.91830000000 88 88 A 450 ASN H A 451 ARG H 1.0 1.79822307692 3.78637692308 89 89 A 450 ASN HBx A 448 TYR HE% 1.0 1.97526923077 5.14373076923 90 90 A 441 ALA H A 440 THR HG21 1.0 2.15584615385 6.52815384615 91 91 A 430 THR HG21 A 431 ALA H 1.0 2.06884615385 5.86115384615 92 92 A 431 ALA H A 430 THR HA 1.0 1.85480769231 4.22019230769 93 93 A 431 ALA H A 430 THR HB 1.0 2.06529230769 5.83390769231 94 94 A 447 TYR HA A 437 GLU HA 1.0 2.05848461538 5.78171538462 95 95 A 438 TYR HBy A 439 LYS H 1.0 1.81539230769 3.91800769231 96 96 A 439 LYS H A 438 TYR HA 1.0 1.67042307692 2.80657692308 97 97 A 446 TYR HE% A 438 TYR HBy 1.0 2.00005384615 5.33374615385 98 98 A 446 TYR H A 438 TYR H 1.0 1.91067692308 4.64852307692 99 99 A 448 TYR HBy A 438 TYR HD% 1.0 1.95496153846 4.98803846154 100 100 A 436 THR HB A 438 TYR HD% 1.0 2.04295384615 5.66264615385 101 101 A 436 THR HB A 438 TYR HE% 1.0 1.86346153846 4.28653846154 102 102 A 448 TYR HBy A 438 TYR HE% 1.0 1.90843846154 4.63136153846 103 103 A 437 GLU HA A 438 TYR H 1.0 1.65032307692 2.65247692308 104 104 A 447 TYR HA A 438 TYR H 1.0 1.96760769231 5.08499230769 105 105 A 446 TYR H A 440 THR HG21 1.0 2.16147692308 6.57132307692 106 106 A 459 LYS H A 458 GLU HBx 1.0 1.95803076923 5.01156923077 107 107 A 463 LEU H A 462 GLU HBx 1.0 2.06529230769 5.83390769231 108 108 A 463 LEU H A 460 PRO HBx 1.0 2.03727692308 5.61912307692 109 109 A 464 LYS H A 463 LEU HD11 1.0 2.19636923077 6.83883076923 110 110 A 464 LYS H A 463 LEU HD21 1.0 2.18441538462 6.74718461538 111 111 A 463 LEU HD21 A 460 PRO HGy 1.0 2.12157692308 6.26542307692 112 112 A 463 LEU HD21 A 460 PRO HGx 1.0 2.15316923077 6.50763076923 113 113 A 445 THR HG21 A 437 GLU HBy 1.0 1.84643076923 4.15596923077 114 114 A 446 TYR HE% A 438 TYR HBx 1.0 2.01556153846 5.45263846154 115 115 A 440 THR HA A 441 ALA HA 1.0 2.03450769231 5.59789230769 116 116 A 436 THR HB A 448 TYR HBx 1.0 2.03180769231 5.57719230769 117 117 A 447 TYR HE% A 459 LYS HGx 1.0 2.03180769231 5.57719230769 118 118 A 447 TYR HE% A 459 LYS HEx 1.0 2.00757692308 5.39142307692 119 119 A 447 TYR HD% A 459 LYS HA 1.0 1.78172307692 3.65987692308 120 120 A 447 TYR HE% A 459 LYS HA 1.0 1.85642307692 4.23257692308 121 121 A 447 TYR HE% A 459 LYS HBx 1.0 2.08636153846 5.99543846154 122 122 A 460 PRO HDx A 459 LYS HGx 1.0 2.01913846154 5.48006153846 123 123 A 463 LEU HD21 A 459 LYS HA 1.0 2.06183076923 5.80736923077 124 124 A 463 LEU HD21 A 460 PRO HDy 1.0 2.06646923077 5.84293076923 125 125 A 460 PRO HDy A 459 LYS HGx 1.0 1.99493076923 5.29446923077 126 126 A 460 PRO HDx A 463 LEU HD21 1.0 2.01913846154 5.48006153846 127 127 A 459 LYS HGx A 463 LEU HG 1.0 2.04893076923 5.70846923077 128 128 A 463 LEU HBx A 459 LYS HGx 1.0 2.06884615385 5.86115384615 129 129 A 463 LEU HD21 A 459 LYS HGx 1.0 2.15053846154 6.48746153846 130 130 A 451 ARG HBy A 452 THR HG21 1.0 2.01438461538 5.44361538462 131 131 A 463 LEU HD21 A 459 LYS HGy 1.0 2.03543076923 5.60496923077 132 132 A 463 LEU HG A 459 LYS HGy 1.0 2.05520769231 5.75659230769 133 133 A 440 THR HB A 441 ALA HB1 1.0 2.06529230769 5.83390769231 134 134 A 440 THR HA A 441 ALA HB1 1.0 2.04690000000 5.69290000000 135 135 A 462 GLU HGy A 463 LEU HD11 1.0 2.11966153846 6.25073846154 136 136 A 448 TYR HBy A 438 TYR HE% 1.0 1.90843846154 4.63136153846 137 137 A 446 TYR HE% A 438 TYR HD% 1.0 2.03589230769 5.60850769231 138 138 A 446 TYR HE% A 438 TYR HE% 1.0 2.11917692308 6.24702307692 139 139 A 428 GLY HAy A 429 ALA H 1.0 2.03180769231 5.57719230769 140 140 A 440 THR H A 446 TYR HE% 1.0 2.05848461538 5.78171538462 141 141 A 432 VAL H A 431 ALA H 1.0 2.02405384615 5.51774615385 142 142 A 452 THR H A 449 ASN HBy 1.0 2.01207692308 5.42592307692 143 143 A 436 THR HG21 A 448 TYR HD% 1.0 2.14306153846 6.43013846154 144 144 A 434 GLU HBy A 449 ASN HD2y 1.0 1.89766153846 4.54873846154 145 145 A 436 THR HG21 A 438 TYR HE% 1.0 2.01556153846 5.45263846154 146 146 A 452 THR H A 449 ASN HBx 1.0 2.08022307692 5.94837692308 147 147 A 448 TYR H A 447 TYR HD% 1.0 2.08428461538 5.97951538462 148 148 A 448 TYR H A 438 TYR HD% 1.0 2.09065384615 6.02834615385 149 149 A 440 THR H A 446 TYR HD% 1.0 2.05520769231 5.75659230769 150 150 A 448 TYR H A 438 TYR HE% 1.0 2.12653846154 6.30346153846 151 151 A 448 TYR HD% A 438 TYR HE% 1.0 1.98950769231 5.25289230769 152 152 A 439 LYS H A 438 TYR HD% 1.0 2.03866153846 5.62973846154 153 153 A 440 THR H A 446 TYR H 1.0 2.09284615385 6.04515384615 154 154 A 439 LYS H A 438 TYR H 1.0 2.03180769231 5.57719230769 155 155 A 445 THR HG21 A 437 GLU HGx 1.0 1.93513846154 4.83606153846 156 156 A 445 THR HG21 A 437 GLU HA 1.0 2.10378461538 6.12901538462 157 157 A 438 TYR H A 437 GLU HBy 1.0 1.78853076923 3.71206923077 158 158 A 437 GLU HGx A 438 TYR H 1.0 1.84091538462 4.11368461538 159 159 A 440 THR H A 439 LYS HGx 1.0 1.74948461538 3.41271538462 160 160 A 461 GLN HA A 464 LYS HGy 1.0 1.99901538462 5.32578461538 161 161 A 461 GLN HA A 464 LYS HBx 1.0 1.99096153846 5.26403846154 162 162 A 440 THR HA A 446 TYR HE% 1.0 1.94974615385 4.94805384615 163 163 A 446 TYR HE% A 448 TYR HBx 1.0 1.97097692308 5.11082307692 164 164 A 446 TYR HE% A 438 TYR HBx 1.0 2.01556153846 5.45263846154 165 165 A 438 TYR HE% A 448 TYR HBx 1.0 1.94261538462 4.89338461538 166 166 A 446 TYR HA A 447 TYR HE% 1.0 2.00111538462 5.34188461538 167 167 A 464 LYS H A 463 LEU HG 1.0 2.15053846154 6.48746153846 168 168 A 450 ASN HBy A 448 TYR HD% 1.0 1.98805384615 5.24174615385 169 169 A 450 ASN HBx A 448 TYR HD% 1.0 2.01323076923 5.43476923077 170 170 A 436 THR HB A 450 ASN HD2x 1.0 2.05202307692 5.73217692308 171 171 A 436 THR HG21 A 450 ASN HD2x 1.0 2.17061538462 6.64138461538 172 172 A 448 TYR H A 437 GLU HA 1.0 2.00757692308 5.39142307692 173 173 A 436 THR HG21 A 438 TYR HD% 1.0 2.07759230769 5.92820769231 174 174 A 448 TYR H A 436 THR HB 1.0 2.05202307692 5.73217692308 175 175 A 449 ASN H A 448 TYR HBy 1.0 2.10214615385 6.11645384615 176 176 A 449 ASN H A 448 TYR HBx 1.0 2.03450769231 5.59789230769 177 177 A 448 TYR H A 447 TYR HBx 1.0 2.02917692308 5.55702307692 178 178 A 437 GLU HA A 438 TYR HD% 1.0 2.07823846154 5.93316153846 179 179 A 447 TYR HA A 438 TYR HD% 1.0 2.09739230769 6.08000769231 180 180 A 447 TYR HA A 437 GLU HBy 1.0 2.06183076923 5.80736923077 181 181 A 445 THR HA A 439 LYS HGx 1.0 1.99901538462 5.32578461538 182 182 A 445 THR HG21 A 439 LYS HEx 1.0 2.10378461538 6.12901538462 183 183 A 460 PRO HDy A 459 LYS HBy 1.0 1.85723076923 4.23876923077 184 184 A 443 GLY H A 439 LYS HGx 1.0 2.07251538462 5.88928461538 185 185 A 451 ARG H A 452 THR HG21 1.0 2.08156153846 5.95863846154 186 186 A 439 LYS H A 438 TYR HBx 1.0 1.93781538462 4.85658461538 187 187 A 446 TYR HE% A 438 TYR HA 1.0 2.13953076923 6.40306923077 188 188 A 434 GLU HA A 450 ASN HD2y 1.0 2.05520769231 5.75659230769 189 189 A 450 ASN HD2x A 434 GLU HA 1.0 2.04009230769 5.64070769231 190 190 A 437 GLU HBy A 445 THR HB 1.0 2.06529230769 5.83390769231 191 191 A 439 LYS HBy A 443 GLY HAx 1.0 2.01673846154 5.46166153846 192 192 A 443 GLY HAx A 439 LYS HGx 1.0 1.97097692308 5.11082307692 193 193 A 439 LYS HGy A 443 GLY HAx 1.0 2.06529230769 5.83390769231 194 194 A 461 GLN HA A 464 LYS HGx 1.0 2.09739230769 6.08000769231 195 195 A 452 THR HG21 A 451 ARG HGx 1.0 2.02405384615 5.51774615385 196 196 A 447 TYR HE% A 445 THR HB 1.0 2.10710769231 6.15449230769 197 197 A 439 LYS HA A 444 LYS H 1.0 2.05520769231 5.75659230769 198 198 A 445 THR H A 444 LYS HBy 1.0 1.90188461538 4.58111538462 199 199 A 440 THR H A 444 LYS HBy 1.0 2.03727692308 5.61912307692 200 200 A 462 GLU H A 461 GLN HGx 1.0 2.00323846154 5.35816153846 201 201 A 440 THR H A 443 GLY H 1.0 2.04590769231 5.68529230769 202 202 A 440 THR H A 444 LYS H 1.0 1.88854615385 4.47885384615 203 203 A 450 ASN H A 452 THR H 1.0 2.08848461538 6.01171538462 204 204 A 449 ASN H A 448 TYR HD% 1.0 2.00538461538 5.37461538462 205 205 A 448 TYR H A 436 THR HG21 1.0 2.17061538462 6.64138461538 206 206 A 443 GLY H A 439 LYS HGy 1.0 2.05520769231 5.75659230769 207 207 A 463 LEU HBx A 459 LYS HGy 1.0 2.07630000000 5.91830000000 208 208 A 432 VAL HG21 A 462 GLU HBy 1.0 1.76229230769 3.51090769231 209 209 A 463 LEU HD21 A 437 GLU HBy 1.0 2.13392307692 6.36007692308 210 210 A 448 TYR HD% A 438 TYR HD% 1.0 2.10094615385 6.10725384615 211 211 A 438 TYR HD% A 448 TYR HBx 1.0 1.95496153846 4.98803846154 212 212 A 446 TYR H A 445 THR HB 1.0 1.96273846154 5.04766153846 213 213 A 449 ASN HD2x A 435 TRP HE1 1.0 2.06529230769 5.83390769231 214 214 A 462 GLU HGy A 435 TRP HE1 1.0 2.00981538462 5.40858461538 215 215 A 434 GLU HBy A 435 TRP HE1 1.0 2.01438461538 5.44361538462 216 216 A 434 GLU HBy A 435 TRP HD1 1.0 1.88464615385 4.44895384615 217 217 A 435 TRP HD1 A 434 GLU HBx 1.0 1.91644615385 4.69275384615 218 218 A 435 TRP HD1 A 434 GLU HGx 1.0 1.88755384615 4.47124615385 219 219 A 446 TYR HBy A 457 TRP HE3 1.0 1.89558461538 4.53281538462 220 220 A 446 TYR HBx A 457 TRP HE3 1.0 1.96273846154 5.04766153846 221 221 A 444 LYS HBy A 457 TRP HE3 1.0 2.00323846154 5.35816153846 222 222 A 434 GLU HA A 435 TRP H 1.0 1.96929230769 5.09790769231 223 223 A 449 ASN HBx A 435 TRP HE3 1.0 2.01207692308 5.42592307692 224 224 A 447 TYR HBy A 435 TRP HE3 1.0 1.75830000000 3.48030000000 225 225 A 447 TYR HBx A 435 TRP HE3 1.0 1.83943846154 4.10236153846 226 226 A 460 PRO HGy A 435 TRP HE3 1.0 2.10214615385 6.11645384615 227 227 A 446 TYR HD% A 457 TRP HZ2 1.0 2.10966923077 6.17413076923 228 228 A 440 THR HG21 A 457 TRP HZ2 1.0 2.07376153846 5.89883846154 229 229 A 462 GLU HGy A 435 TRP HD1 1.0 1.94053846154 4.87746153846 230 230 A 462 GLU HBy A 435 TRP HD1 1.0 2.01913846154 5.48006153846 231 231 A 460 PRO HGy A 435 TRP HD1 1.0 2.08848461538 6.01171538462 232 232 A 449 ASN HBy A 435 TRP HH2 1.0 2.08428461538 5.97951538462 233 233 A 449 ASN HBx A 435 TRP HH2 1.0 2.00981538462 5.40858461538 234 234 A 440 THR HG21 A 457 TRP HH2 1.0 1.89558461538 4.53281538462 235 235 A 447 TYR HBy A 435 TRP HZ3 1.0 1.83724615385 4.08555384615 236 236 A 447 TYR HBx A 435 TRP HZ3 1.0 1.93781538462 4.85658461538 237 237 A 449 ASN HBy A 435 TRP HZ3 1.0 1.87170000000 4.34970000000 238 238 A 449 ASN HBx A 435 TRP HZ3 1.0 1.92364615385 4.74795384615 239 239 A 446 TYR HD% A 457 TRP HZ3 1.0 1.95122307692 4.95937692308 240 240 A 447 TYR HE% A 457 TRP HA 1.0 2.04443076923 5.67396923077 241 241 A 446 TYR HA A 457 TRP HZ3 1.0 2.02405384615 5.51774615385 242 242 A 444 LYS HA A 457 TRP HZ3 1.0 2.06183076923 5.80736923077 243 243 A 446 TYR HBy A 457 TRP HZ3 1.0 1.93121538462 4.80598461538 244 244 A 446 TYR HBx A 457 TRP HZ3 1.0 2.00323846154 5.35816153846 245 245 A 444 LYS HBy A 457 TRP HZ3 1.0 1.81283076923 3.89836923077 246 246 A 440 THR HG21 A 457 TRP HZ3 1.0 1.93601538462 4.84278461538 247 247 A 457 TRP HBx A 458 GLU H 1.0 1.98334615385 5.20565384615 248 248 A 458 GLU H A 457 TRP HBy 1.0 2.05520769231 5.75659230769 249 249 A 457 TRP HA A 458 GLU H 1.0 1.95803076923 5.01156923077 250 250 A 436 THR H A 435 TRP HA 1.0 1.71309230769 3.13370769231 251 251 A 450 ASN H A 435 TRP HA 1.0 1.94612307692 4.92027692308 252 252 A 446 TYR HD% A 457 TRP HE3 1.0 2.07066923077 5.87513076923 253 253 A 434 GLU HBy A 435 TRP H 1.0 2.01207692308 5.42592307692 254 254 A 435 TRP H A 434 GLU HGy 1.0 1.98152307692 5.19167692308 255 255 A 434 GLU HGx A 435 TRP H 1.0 1.97097692308 5.11082307692 256 256 A 434 GLU HBx A 435 TRP H 1.0 1.97614615385 5.15045384615 257 257 A 449 ASN H A 435 TRP HZ3 1.0 1.87991538462 4.41268461538 258 258 A 452 THR HG21 A 449 ASN HD2y 1.0 2.08991538462 6.02268461538 259 259 A 449 ASN HA A 435 TRP HE3 1.0 1.93781538462 4.85658461538 260 260 A 449 ASN HA A 435 TRP HA 1.0 1.98334615385 5.20565384615 261 261 A 444 LYS HBx A 457 TRP HE3 1.0 1.97614615385 5.15045384615 262 262 A 445 THR HA A 446 TYR HD% 1.0 1.93915384615 4.86684615385 263 263 A 434 GLU H A 435 TRP HD1 1.0 2.15053846154 6.48746153846 264 264 A 433 SER H A 432 VAL HG11 1.0 2.07503076923 5.90856923077 265 265 A 448 TYR H A 447 TYR HE% 1.0 2.20779230769 6.92640769231 266 266 A 439 LYS HBx A 443 GLY HAx 1.0 1.97790000000 5.16390000000 267 267 A 446 TYR H A 438 TYR HBx 1.0 2.10214615385 6.11645384615 268 268 A 447 TYR HA A 435 TRP HZ3 1.0 2.14306153846 6.43013846154 269 269 A 442 ASP HBy A 444 LYS H 1.0 2.10214615385 6.11645384615 270 270 A 444 LYS H A 442 ASP HBx 1.0 2.15053846154 6.48746153846 271 271 A 436 THR H A 435 TRP HBy 1.0 1.98152307692 5.19167692308 272 272 A 436 THR H A 435 TRP HBx 1.0 1.95196153846 4.96503846154 273 273 A 443 GLY HAx A 439 LYS HDx 1.0 2.02917692308 5.55702307692 274 274 A 429 ALA HB1 A 430 THR H 1.0 2.13613846154 6.37706153846 275 275 A 430 THR H A 429 ALA HA 1.0 1.41830000000 2.41830000000 276 276 A 446 TYR HE% A 439 LYS H 1.0 2.15053846154 6.48746153846 277 277 A 448 TYR HA A 438 TYR HE% 1.0 2.13613846154 6.37706153846 278 278 A 449 ASN H A 455 SER HA 1.0 1.98334615385 5.20565384615 279 279 A 448 TYR HD% A 455 SER HA 1.0 2.00538461538 5.37461538462 280 280 A 446 TYR HD% A 455 SER HA 1.0 2.09974615385 6.09805384615 281 281 A 452 THR HG21 A 453 LEU H 1.0 2.11776923077 6.23623076923 282 282 A 449 ASN HBx A 453 LEU H 1.0 2.10710769231 6.15449230769 283 283 A 452 THR H A 453 LEU HD21 1.0 2.15053846154 6.48746153846 284 284 A 453 LEU H A 452 THR HA 1.0 1.94053846154 4.87746153846 285 285 A 453 LEU H A 452 THR HB 1.0 2.02405384615 5.51774615385 286 286 A 444 LYS HA A 443 GLY H 1.0 2.12353846154 6.28046153846 287 287 A 442 ASP HA A 444 LYS H 1.0 1.95343846154 4.97636153846 288 288 A 450 ASN H A 448 TYR HD% 1.0 2.13613846154 6.37706153846 289 289 A 450 ASN H A 448 TYR HE% 1.0 2.15861538462 6.54938461538 290 290 A 450 ASN H A 451 ARG H 1.0 1.78197692308 3.66182307692 291 291 A 448 TYR H A 446 TYR HD% 1.0 2.08428461538 5.97951538462 292 292 A 449 ASN HA A 436 THR H 1.0 2.03180769231 5.57719230769 293 293 A 450 ASN HA A 448 TYR HD% 1.0 1.99493076923 5.29446923077 294 294 A 450 ASN HA A 448 TYR HE% 1.0 1.82598461538 3.99921538462 295 295 A 440 THR H A 443 GLY HAx 1.0 2.15861538462 6.54938461538 296 296 A 440 THR H A 443 GLY HAy 1.0 2.07251538462 5.88928461538 297 297 A 446 TYR HD% A 438 TYR H 1.0 2.08022307692 5.94837692308 298 298 A 444 LYS H A 440 THR HG21 1.0 2.04198461538 5.65521538462 299 299 A 445 THR H A 444 LYS HGx 1.0 2.00538461538 5.37461538462 300 300 A 445 THR H A 439 LYS HGx 1.0 2.08428461538 5.97951538462 301 301 A 447 TYR H A 445 THR HG21 1.0 2.15584615385 6.52815384615 302 302 A 440 THR H A 445 THR HG21 1.0 2.21028461538 6.94551538462 303 303 A 447 TYR H A 457 TRP HBy 1.0 2.15053846154 6.48746153846 304 304 A 436 THR HB A 435 TRP HA 1.0 2.08428461538 5.97951538462 305 305 A 446 TYR HA A 457 TRP HBx 1.0 2.04009230769 5.64070769231 306 306 A 445 THR HA A 446 TYR HBx 1.0 1.97614615385 5.15045384615 307 307 A 445 THR HA A 439 LYS HBx 1.0 1.91067692308 4.64852307692 308 308 A 448 TYR HA A 455 SER HA 1.0 1.99901538462 5.32578461538 309 309 A 462 GLU H A 461 GLN HBx 1.0 1.87082307692 4.34297692308 310 310 A 461 GLN H A 460 PRO HBy 1.0 1.94757692308 4.93142307692 311 311 A 461 GLN H A 460 PRO HBy 1.0 1.94757692308 4.93142307692 312 312 A 464 LYS H A 463 LEU HBy 1.0 1.98521538462 5.21998461538 313 313 A 433 SER HBx A 435 TRP H 1.0 2.02405384615 5.51774615385 314 314 A 433 SER HBy A 435 TRP H 1.0 2.06183076923 5.80736923077 315 315 A 460 PRO HDx A 459 LYS HA 1.0 1.72239230769 3.20500769231 316 316 A 447 TYR HD% A 435 TRP HBx 1.0 2.08636153846 5.99543846154 317 317 A 463 LEU HD11 A 459 LYS HA 1.0 2.13613846154 6.37706153846 318 318 A 463 LEU HD11 A 435 TRP HE1 1.0 2.22106153846 7.02813846154 319 319 A 435 TRP HE1 A 460 PRO HBy 1.0 2.02917692308 5.55702307692 320 320 A 435 TRP HE1 A 462 GLU HGx 1.0 2.01438461538 5.44361538462 321 321 A 444 LYS HBy A 457 TRP HH2 1.0 1.97439230769 5.13700769231 322 322 A 464 LYS H A 463 LEU HA 1.0 1.82127692308 3.96312307692 323 323 A 462 GLU HA A 464 LYS H 1.0 2.08428461538 5.97951538462 324 324 A 459 LYS H A 458 GLU HGx 1.0 2.01913846154 5.48006153846 325 325 A 459 LYS H A 458 GLU HGy 1.0 1.98152307692 5.19167692308 326 326 A 447 TYR HD% A 463 LEU HD11 1.0 2.05682307692 5.76897692308 327 327 A 449 ASN HD2y A 434 GLU HBx 1.0 1.97439230769 5.13700769231 328 328 A 448 TYR HD% A 455 SER HBy 1.0 1.92927692308 4.79112307692 329 329 A 448 TYR HD% A 455 SER HBx 1.0 1.89976153846 4.56483846154 330 330 A 436 THR H A 447 TYR HD% 1.0 2.17223076923 6.65376923077 331 331 A 436 THR H A 435 TRP HE3 1.0 1.95648461538 4.99971538462 332 332 A 436 THR H A 448 TYR HD% 1.0 2.15861538462 6.54938461538 333 333 A 447 TYR H A 446 TYR HD% 1.0 1.85561538462 4.22638461538 334 334 A 436 THR H A 435 TRP H 1.0 2.08022307692 5.94837692308 335 335 A 450 ASN H A 436 THR H 1.0 2.09284615385 6.04515384615 336 336 A 448 TYR HE% A 453 LEU H 1.0 2.13953076923 6.40306923077 337 337 A 460 PRO HBx A 435 TRP HZ2 1.0 2.09284615385 6.04515384615 338 338 A 458 GLU HA A 447 TYR HE% 1.0 2.05848461538 5.78171538462 339 339 A 447 TYR HE% A 463 LEU HD11 1.0 2.02363846154 5.51456153846 340 340 A 436 THR HB A 450 ASN HD2y 1.0 2.01438461538 5.44361538462 341 341 A 436 THR HG21 A 450 ASN HD2y 1.0 2.13613846154 6.37706153846 342 342 A 442 ASP H A 440 THR HG21 1.0 2.07630000000 5.91830000000 343 343 A 445 THR HG21 A 438 TYR H 1.0 2.04009230769 5.64070769231 344 344 A 450 ASN H A 434 GLU HBx 1.0 2.01673846154 5.46166153846 345 345 A 450 ASN H A 434 GLU HBy 1.0 1.98710769231 5.23449230769 346 346 A 451 ARG H A 453 LEU HA 1.0 2.12963076923 6.32716923077 347 347 A 452 THR H A 453 LEU HA 1.0 2.00323846154 5.35816153846 348 348 A 440 THR H A 444 LYS HA 1.0 2.09284615385 6.04515384615 349 349 A 434 GLU H A 435 TRP H 1.0 1.95343846154 4.97636153846 350 350 A 445 THR H A 444 LYS H 1.0 2.07630000000 5.91830000000 351 351 A 447 TYR HA A 448 TYR HBy 1.0 2.06884615385 5.86115384615 352 352 A 445 THR HA A 440 THR HG21 1.0 2.10053076923 6.10406923077 353 353 A 434 GLU HBy A 451 ARG HDy 1.0 2.00323846154 5.35816153846 354 354 A 434 GLU HBy A 451 ARG HDx 1.0 1.95048461538 4.95371538462 355 355 A 440 THR HA A 446 TYR HD% 1.0 2.13613846154 6.37706153846 356 356 A 450 ASN HA A 453 LEU HD21 1.0 2.02405384615 5.51774615385 357 357 A 461 GLN HA A 464 LYS HDx 1.0 1.88083846154 4.41976153846 358 358 A 445 THR H A 444 LYS HDx 1.0 2.11230000000 6.19430000000 359 359 A 448 TYR HE% A 453 LEU HA 1.0 1.92611538462 4.76688461538 360 360 A 448 TYR HE% A 455 SER HBy 1.0 2.01438461538 5.44361538462 361 361 A 448 TYR HE% A 455 SER HBx 1.0 2.05848461538 5.78171538462 362 362 A 446 TYR HD% A 455 SER HBy 1.0 1.89558461538 4.53281538462 363 363 A 446 TYR HD% A 455 SER HBx 1.0 1.89713076923 4.54466923077 364 364 A 448 TYR HE% A 453 LEU HBy 1.0 2.10966923077 6.17413076923 365 365 A 448 TYR HE% A 453 LEU HBx 1.0 2.04295384615 5.66264615385 366 366 A 448 TYR HE% A 453 LEU HG 1.0 2.16295384615 6.58264615385 367 367 A 448 TYR HE% A 453 LEU HD11 1.0 2.15450769231 6.51789230769 368 368 A 448 TYR HE% A 453 LEU HD21 1.0 2.04152307692 5.65167692308 369 369 A 446 TYR HE% A 455 SER HBx 1.0 1.98902307692 5.24917692308 370 370 A 446 TYR HE% A 444 LYS HBy 1.0 2.11230000000 6.19430000000 371 371 A 463 LEU HD21 A 435 TRP HD1 1.0 2.09434615385 6.05665384615 372 372 A 463 LEU HD11 A 435 TRP HD1 1.0 2.06884615385 5.86115384615 373 373 A 440 THR H A 439 LYS H 1.0 2.06884615385 5.86115384615 374 374 A 451 ARG H A 450 ASN HD2x 1.0 2.12353846154 6.28046153846 375 375 A 440 THR HG21 A 444 LYS HBy 1.0 1.95699230769 5.00360769231 376 376 A 458 GLU HA A 447 TYR HD% 1.0 2.12963076923 6.32716923077 377 377 A 457 TRP HZ3 A 444 LYS HEx 1.0 2.07630000000 5.91830000000 378 378 A 446 TYR HBy A 457 TRP HH2 1.0 2.10214615385 6.11645384615 379 379 A 460 PRO HA A 461 GLN HBy 1.0 2.04009230769 5.64070769231 380 380 A 460 PRO HBx A 462 GLU HGy 1.0 2.05202307692 5.73217692308 381 381 A 449 ASN HBy A 453 LEU H 1.0 1.98710769231 5.23449230769 382 382 A 436 THR HG21 A 438 TYR H 1.0 2.03180769231 5.57719230769 383 383 A 463 LEU H A 462 GLU HGx 1.0 2.00538461538 5.37461538462 384 384 A 446 TYR H A 438 TYR H 1.0 1.89353076923 4.51706923077 385 385 A 447 TYR HBy A 435 TRP HH2 1.0 1.93121538462 4.80598461538 386 386 A 444 LYS H A 457 TRP HZ3 1.0 2.10710769231 6.15449230769 387 387 A 451 ARG H A 453 LEU H 1.0 1.96596923077 5.07243076923 388 388 A 464 LYS HGy A 461 GLN HE2x 1.0 2.12963076923 6.32716923077 389 389 A 457 TRP HZ3 A 444 LYS HGx 1.0 2.00981538462 5.40858461538 390 390 A 457 TRP HZ3 A 444 LYS HGy 1.0 1.98334615385 5.20565384615 391 391 A 457 TRP HZ3 A 444 LYS HDx 1.0 1.96435384615 5.06004615385 392 392 A 457 TRP HE3 A 444 LYS HDy 1.0 1.95957692308 5.02342307692 393 393 A 457 TRP HE3 A 444 LYS HDx 1.0 1.93250769231 4.81589230769 394 394 A 457 TRP HE3 A 444 LYS HGy 1.0 2.04009230769 5.64070769231 395 395 A 457 TRP HE3 A 444 LYS HGx 1.0 2.08022307692 5.94837692308 396 396 A 452 THR HG21 A 449 ASN HD2x 1.0 2.14550769231 6.44889230769 397 397 A 434 GLU HBy A 449 ASN HD2x 1.0 2.07630000000 5.91830000000 398 398 A 449 ASN HD2x A 434 GLU HBx 1.0 2.01913846154 5.48006153846 399 399 A 458 GLU H A 457 TRP H 1.0 1.77256153846 3.58963846154 400 400 A 460 PRO HBx A 435 TRP HE1 1.0 2.08848461538 6.01171538462 401 401 A 446 TYR HD% A 444 LYS HBy 1.0 2.17223076923 6.65376923077 402 402 A 463 LEU HG A 435 TRP HD1 1.0 2.08022307692 5.94837692308 403 403 A 450 ASN HBy A 453 LEU H 1.0 2.11230000000 6.19430000000 404 404 A 450 ASN HBx A 453 LEU H 1.0 2.12353846154 6.28046153846 405 405 A 452 THR H A 450 ASN HBy 1.0 2.16747692308 6.61732307692 406 406 A 445 THR H A 444 LYS HGy 1.0 1.98152307692 5.19167692308 407 407 A 446 TYR H A 444 LYS HGy 1.0 2.07630000000 5.91830000000 408 408 A 441 ALA H A 446 TYR HE% 1.0 2.10459230769 6.13520769231 409 409 A 452 THR HB A 453 LEU HD11 1.0 2.21550000000 6.98550000000 410 410 A 443 GLY H A 444 LYS HGx 1.0 2.05520769231 5.75659230769 411 411 A 443 GLY H A 444 LYS HGy 1.0 2.04009230769 5.64070769231 412 412 A 443 GLY H A 444 LYS HBx 1.0 2.05520769231 5.75659230769 413 413 A 443 GLY H A 444 LYS HBy 1.0 2.08022307692 5.94837692308 414 414 A 463 LEU HD21 A 435 TRP HE3 1.0 2.17723846154 6.69216153846 415 415 A 463 LEU HD11 A 435 TRP HE3 1.0 2.15316923077 6.50763076923 416 416 A 448 TYR HA A 438 TYR HD% 1.0 2.17223076923 6.65376923077 417 417 A 451 ARG H A 453 LEU HD21 1.0 2.15861538462 6.54938461538 418 418 A 455 SER HA A 456 THR H 1.0 1.78197692308 3.66182307692 419 419 A 455 SER HBx A 456 THR H 1.0 1.87350000000 4.36350000000 420 420 A 455 SER HBx A 456 THR H 1.0 1.87350000000 4.36350000000 421 421 A 455 SER HBy A 456 THR H 1.0 1.93380000000 4.82580000000 422 422 A 447 TYR HBx A 456 THR H 1.0 2.06529230769 5.83390769231 423 423 A 447 TYR HBy A 456 THR H 1.0 2.06183076923 5.80736923077 424 424 A 453 LEU HD21 A 454 TYR H 1.0 2.13840000000 6.39440000000 425 425 A 453 LEU HD11 A 454 TYR H 1.0 2.17723846154 6.69216153846 426 426 A 452 THR HG21 A 454 TYR H 1.0 2.15584615385 6.52815384615 427 427 A 453 LEU HG A 454 TYR H 1.0 2.11230000000 6.19430000000 428 428 A 453 LEU HBx A 454 TYR H 1.0 2.12963076923 6.32716923077 429 429 A 453 LEU HBy A 454 TYR H 1.0 2.12963076923 6.32716923077 430 430 A 452 THR HB A 454 TYR H 1.0 2.04295384615 5.66264615385 431 431 A 449 ASN HA A 454 TYR H 1.0 1.99493076923 5.29446923077 432 432 A 454 TYR HA A 455 SER H 1.0 1.68316153846 2.90423846154 433 433 A 455 SER H A 454 TYR HBy 1.0 1.96273846154 5.04766153846 434 434 A 455 SER H A 454 TYR HBx 1.0 1.98334615385 5.20565384615 435 435 A 453 LEU HA A 454 TYR H 1.0 1.88854615385 4.47885384615 436 436 A 449 ASN HA A 454 TYR HE% 1.0 1.91067692308 4.64852307692 437 437 A 449 ASN HA A 454 TYR HD% 1.0 2.04295384615 5.66264615385 438 438 A 452 THR HB A 454 TYR HD% 1.0 2.01323076923 5.43476923077 439 439 A 452 THR HB A 454 TYR HD% 1.0 2.01323076923 5.43476923077 440 440 A 452 THR HG21 A 454 TYR HD% 1.0 2.17386923077 6.66633076923 441 441 A 452 THR HG21 A 454 TYR HE% 1.0 2.20303846154 6.88996153846 442 442 A 457 TRP H A 456 THR HA 1.0 1.67766923077 2.86213076923 443 443 A 455 SER HBy A 457 TRP H 1.0 2.00323846154 5.35816153846 444 444 A 457 TRP H A 456 THR HB 1.0 1.94330769231 4.89869230769 445 445 A 457 TRP H A 456 THR HG21 1.0 2.09284615385 6.04515384615 446 446 A 456 THR HA A 457 TRP HE1 1.0 2.11776923077 6.23623076923 447 447 A 460 PRO HGy A 435 TRP HE1 1.0 2.15861538462 6.54938461538 448 448 A 460 PRO HGx A 435 TRP HE1 1.0 2.20075384615 6.87244615385 449 449 A 449 ASN HBy A 454 TYR HBy 1.0 2.03180769231 5.57719230769 450 450 A 449 ASN HBy A 454 TYR HBx 1.0 1.99292307692 5.27907692308 451 451 A 460 PRO HGy A 435 TRP HZ2 1.0 2.12963076923 6.32716923077 452 452 A 460 PRO HGx A 435 TRP HZ2 1.0 2.07630000000 5.91830000000 453 453 A 458 GLU H A 456 THR HG21 1.0 1.96652307692 5.07667692308 454 454 A 447 TYR H A 456 THR HG21 1.0 2.08428461538 5.97951538462 455 455 A 440 THR H A 444 LYS HBx 1.0 2.05520769231 5.75659230769 456 456 A 435 TRP HZ3 A 456 THR HG21 1.0 1.89251538462 4.50928461538 457 457 A 454 TYR HD% A 456 THR HG21 1.0 2.11684615385 6.22915384615 458 458 A 447 TYR HD% A 456 THR HG21 1.0 2.00649230769 5.38310769231 459 459 A 447 TYR HE% A 456 THR HG21 1.0 2.03093076923 5.57046923077 460 460 A 449 ASN HBx A 435 TRP HZ2 1.0 2.06529230769 5.83390769231 461 461 A 452 THR HB A 454 TYR HE% 1.0 2.10214615385 6.11645384615 462 462 A 449 ASN HBy A 454 TYR HD% 1.0 2.09510769231 6.06249230769 463 463 A 449 ASN HBy A 454 TYR HE% 1.0 2.15053846154 6.48746153846 464 464 A 457 TRP HH2 A 444 LYS HGy 1.0 2.02659230769 5.53720769231 465 465 A 446 TYR HE% A 438 TYR HD% 1.0 2.07923076923 5.94076923077 466 466 A 435 TRP HH2 A 454 TYR HD% 1.0 1.90899230769 4.63560769231 467 467 A 435 TRP HH2 A 454 TYR HE% 1.0 1.99292307692 5.27907692308 468 468 A 436 THR HA A 450 ASN HD2y 1.0 1.73423076923 3.29576923077 469 469 A 455 SER H A 454 TYR HD% 1.0 2.04009230769 5.64070769231 470 470 A 444 LYS H A 446 TYR HE% 1.0 2.04740769231 5.69679230769 471 471 A 447 TYR HBy A 436 THR H 1.0 2.10214615385 6.11645384615 472 472 A 436 THR H A 463 LEU HD21 1.0 2.20075384615 6.87244615385 473 473 A 444 LYS HBx A 457 TRP HH2 1.0 1.96929230769 5.09790769231 474 474 A 444 LYS HBx A 457 TRP HZ3 1.0 1.78631538462 3.69508461538 475 475 A 446 TYR HE% A 444 LYS HGy 1.0 2.10710769231 6.15449230769 476 476 A 444 LYS HBx A 446 TYR HE% 1.0 2.10710769231 6.15449230769 477 477 A 460 PRO HGx A 435 TRP HD1 1.0 2.09284615385 6.04515384615 478 478 A 460 PRO HGx A 435 TRP HZ3 1.0 2.11230000000 6.19430000000 479 479 A 435 TRP HH2 A 456 THR HG21 1.0 1.95244615385 4.96875384615 480 480 A 460 PRO HGx A 435 TRP HH2 1.0 2.11230000000 6.19430000000 481 481 A 446 TYR HD% A 438 TYR HBx 1.0 2.11776923077 6.23623076923 482 482 A 446 TYR HD% A 438 TYR HA 1.0 2.11500000000 6.21500000000 483 483 A 458 GLU H A 456 THR HB 1.0 2.02405384615 5.51774615385 484 484 A 463 LEU H A 460 PRO HGy 1.0 2.13613846154 6.37706153846 485 485 A 463 LEU HD21 A 459 LYS HGy 1.0 2.13613846154 6.37706153846 486 486 A 463 LEU HD21 A 459 LYS HGx 1.0 2.15053846154 6.48746153846 487 487 A 459 LYS HGy A 463 LEU HBy 1.0 2.06884615385 5.86115384615 488 488 A 459 LYS HGx A 463 LEU HBy 1.0 2.09284615385 6.04515384615 489 489 A 460 PRO HDx A 459 LYS HGy 1.0 2.01207692308 5.42592307692 490 490 A 436 THR HA A 449 ASN HBy 1.0 2.00323846154 5.35816153846 491 491 A 463 LEU HD11 A 435 TRP HBy 1.0 2.10378461538 6.12901538462 492 492 A 463 LEU HD11 A 435 TRP HBx 1.0 2.08991538462 6.02268461538 493 493 A 463 LEU HD21 A 435 TRP HBy 1.0 2.08428461538 5.97951538462 494 494 A 463 LEU HD21 A 435 TRP HBx 1.0 2.07630000000 5.91830000000 495 495 A 436 THR HA A 463 LEU HD21 1.0 2.18441538462 6.74718461538 496 496 A 451 ARG H A 450 ASN HD2y 1.0 2.08022307692 5.94837692308 497 497 A 435 TRP HE3 A 456 THR HG21 1.0 2.04198461538 5.65521538462 498 498 A 447 TYR HE% A 460 PRO HGx 1.0 2.16295384615 6.58264615385 499 499 A 460 PRO HGx A 435 TRP HE3 1.0 2.06529230769 5.83390769231 500 500 A 447 TYR HD% A 437 GLU HBx 1.0 1.89558461538 4.53281538462 501 501 A 447 TYR HD% A 437 GLU HGx 1.0 1.93446923077 4.83093076923 502 502 A 447 TYR HD% A 435 TRP HE3 1.0 2.02532307692 5.52747692308 503 503 A 449 ASN HBy A 454 TYR H 1.0 1.89053076923 4.49406923077 504 504 A 447 TYR HE% A 459 LYS HDy 1.0 2.04152307692 5.65167692308 505 505 A 461 GLN HA A 464 LYS H 1.0 2.01913846154 5.48006153846 506 506 A 461 GLN HA A 463 LEU H 1.0 2.06529230769 5.83390769231 507 507 A 447 TYR HA A 435 TRP HE3 1.0 1.99696153846 5.31003846154 508 508 A 448 TYR HBx A 455 SER HA 1.0 2.06884615385 5.86115384615 509 509 A 447 TYR HA A 448 TYR HBx 1.0 2.08428461538 5.97951538462 510 510 A 448 TYR HA A 447 TYR HBy 1.0 2.11230000000 6.19430000000 511 511 A 448 TYR HA A 449 ASN HBy 1.0 2.06183076923 5.80736923077 512 512 A 445 THR HA A 439 LYS HBy 1.0 2.08848461538 6.01171538462 513 513 A 458 GLU HBy A 457 TRP HA 1.0 2.12963076923 6.32716923077 514 514 A 448 TYR HA A 449 ASN HBx 1.0 2.11230000000 6.19430000000 515 515 A 456 THR HA A 457 TRP HD1 1.0 1.93250769231 4.81589230769 516 516 A 458 GLU H A 456 THR HA 1.0 1.95343846154 4.97636153846 517 517 A 446 TYR HA A 457 TRP HE3 1.0 1.90188461538 4.58111538462 518 518 A 446 TYR HA A 445 THR HG21 1.0 2.07759230769 5.92820769231 519 519 A 439 LYS HA A 445 THR HG21 1.0 2.08156153846 5.95863846154 520 520 A 462 GLU HA A 463 LEU HA 1.0 2.11230000000 6.19430000000 521 521 A 458 GLU HA A 457 TRP HBx 1.0 2.09739230769 6.08000769231 522 522 A 451 ARG HA A 453 LEU HD21 1.0 2.10053076923 6.10406923077 523 523 A 445 THR HG21 A 447 TYR HD% 1.0 2.05959230769 5.79020769231 524 524 A 447 TYR HBy A 456 THR HB 1.0 1.97614615385 5.15045384615 525 525 A 452 THR HB A 454 TYR HBy 1.0 2.05848461538 5.78171538462 526 526 A 439 LYS HGy A 443 GLY HAy 1.0 2.08428461538 5.97951538462 527 527 A 441 ALA HA A 439 LYS HBy 1.0 2.06529230769 5.83390769231 528 528 A 441 ALA HA A 439 LYS HBx 1.0 2.06183076923 5.80736923077 529 529 A 453 LEU HD21 A 452 THR HB 1.0 2.12963076923 6.32716923077 530 530 A 451 ARG HGy A 452 THR HA 1.0 2.05848461538 5.78171538462 531 531 A 433 SER HBy A 431 ALA HB1 1.0 2.16747692308 6.61732307692 532 532 A 452 THR HA A 453 LEU HG 1.0 2.00981538462 5.40858461538 533 533 A 452 THR HA A 453 LEU HD11 1.0 2.11054615385 6.18085384615 534 534 A 453 LEU HD21 A 452 THR HA 1.0 2.11230000000 6.19430000000 535 535 A 460 PRO HA A 461 GLN HBx 1.0 2.05202307692 5.73217692308 536 536 A 433 SER HBx A 432 VAL HG21 1.0 2.08022307692 5.94837692308 537 537 A 446 TYR HBx A 457 TRP HBy 1.0 2.11230000000 6.19430000000 538 538 A 460 PRO HGy A 435 TRP HBx 1.0 2.11776923077 6.23623076923 539 539 A 460 PRO HGx A 435 TRP HBx 1.0 2.12353846154 6.28046153846 540 540 A 447 TYR HBy A 456 THR HG21 1.0 1.95343846154 4.97636153846 541 541 A 459 LYS HA A 463 LEU HBy 1.0 2.04295384615 5.66264615385 542 542 A 450 ASN HBx A 453 LEU HBx 1.0 2.03180769231 5.57719230769 543 543 A 463 LEU HBx A 459 LYS HA 1.0 2.01438461538 5.44361538462 544 544 A 446 TYR HBy A 440 THR HG21 1.0 2.16147692308 6.57132307692 545 545 A 446 TYR HBx A 440 THR HG21 1.0 2.17723846154 6.69216153846 546 546 A 462 GLU HGy A 463 LEU HD21 1.0 2.17386923077 6.66633076923 547 547 A 460 PRO HDx A 459 LYS HBx 1.0 2.03450769231 5.59789230769 548 548 A 463 LEU HD21 A 437 GLU HGx 1.0 2.14070769231 6.41209230769 549 549 A 451 ARG HGy A 452 THR HG21 1.0 2.08428461538 5.97951538462 550 550 A 459 LYS HBx A 464 LYS HDx 1.0 2.04009230769 5.64070769231 551 551 A 439 LYS HBx A 445 THR HG21 1.0 2.04590769231 5.68529230769 552 552 A 439 LYS HBy A 445 THR HG21 1.0 2.20539230769 6.90800769231 553 553 A 446 TYR HE% A 455 SER HBy 1.0 1.94400000000 4.90400000000 554 554 A 435 TRP HZ3 A 454 TYR HD% 1.0 1.92120000000 4.72920000000 555 555 A 435 TRP HZ2 A 454 TYR HD% 1.0 2.07251538462 5.88928461538 556 556 A 446 TYR HD% A 457 TRP HH2 1.0 2.07438461538 5.90361538462 557 557 A 458 GLU HBx A 457 TRP H 1.0 2.01438461538 5.44361538462 558 558 A 447 TYR HE% A 463 LEU HBy 1.0 2.12653846154 6.30346153846 559 559 A 463 LEU HBx A 447 TYR HE% 1.0 2.16295384615 6.58264615385 560 560 A 449 ASN HD2y A 435 TRP HZ2 1.0 1.95048461538 4.95371538462 561 561 A 453 LEU H A 454 TYR H 1.0 1.87170000000 4.34970000000 562 562 A 448 TYR HE% A 455 SER H 1.0 2.17723846154 6.69216153846 563 563 A 446 TYR HE% A 457 TRP HZ3 1.0 2.11776923077 6.23623076923 564 564 A 446 TYR HD% A 456 THR H 1.0 2.05202307692 5.73217692308 565 565 A 449 ASN HD2x A 435 TRP HA 1.0 2.06884615385 5.86115384615 566 566 A 451 ARG HGx A 454 TYR HE% 1.0 2.13283846154 6.35176153846 567 567 A 449 ASN H A 453 LEU HA 1.0 2.10710769231 6.15449230769 568 568 A 435 TRP HH2 A 456 THR HB 1.0 2.02659230769 5.53720769231 569 569 A 447 TYR HD% A 458 GLU H 1.0 2.12653846154 6.30346153846 570 570 A 447 TYR H A 456 THR H 1.0 1.95803076923 5.01156923077 571 571 A 439 LYS HBy A 438 TYR HD% 1.0 2.13613846154 6.37706153846 572 572 A 438 TYR HA A 437 GLU HBy 1.0 1.91411538462 4.67488461538 573 573 A 437 GLU HGx A 438 TYR HA 1.0 2.01438461538 5.44361538462 574 574 A 452 THR H A 451 ARG HGx 1.0 2.04295384615 5.66264615385 575 575 A 435 TRP HZ3 A 454 TYR HBy 1.0 1.85083846154 4.18976153846 576 576 A 435 TRP HZ3 A 454 TYR HBx 1.0 1.86053076923 4.26406923077 577 577 A 454 TYR HE% A 456 THR HG21 1.0 2.04103846154 5.64796153846 578 578 A 451 ARG HBy A 452 THR HA 1.0 2.08848461538 6.01171538462 579 579 A 451 ARG HGx A 452 THR HA 1.0 1.98521538462 5.21998461538 580 580 A 453 LEU HD21 A 452 THR HA 1.0 2.11230000000 6.19430000000 stop_ save_